全文获取类型
收费全文 | 4212篇 |
免费 | 231篇 |
国内免费 | 11篇 |
专业分类
化学 | 2850篇 |
晶体学 | 75篇 |
力学 | 94篇 |
数学 | 725篇 |
物理学 | 710篇 |
出版年
2023年 | 55篇 |
2022年 | 47篇 |
2021年 | 84篇 |
2020年 | 101篇 |
2019年 | 124篇 |
2018年 | 64篇 |
2017年 | 45篇 |
2016年 | 162篇 |
2015年 | 128篇 |
2014年 | 146篇 |
2013年 | 203篇 |
2012年 | 246篇 |
2011年 | 311篇 |
2010年 | 173篇 |
2009年 | 118篇 |
2008年 | 192篇 |
2007年 | 169篇 |
2006年 | 163篇 |
2005年 | 158篇 |
2004年 | 125篇 |
2003年 | 94篇 |
2002年 | 102篇 |
2001年 | 60篇 |
2000年 | 47篇 |
1999年 | 36篇 |
1998年 | 53篇 |
1997年 | 44篇 |
1996年 | 52篇 |
1995年 | 51篇 |
1994年 | 41篇 |
1993年 | 60篇 |
1992年 | 48篇 |
1991年 | 36篇 |
1990年 | 40篇 |
1989年 | 40篇 |
1988年 | 44篇 |
1987年 | 47篇 |
1986年 | 33篇 |
1985年 | 51篇 |
1984年 | 52篇 |
1983年 | 36篇 |
1982年 | 34篇 |
1981年 | 31篇 |
1980年 | 44篇 |
1979年 | 29篇 |
1978年 | 28篇 |
1977年 | 31篇 |
1976年 | 28篇 |
1975年 | 20篇 |
1974年 | 26篇 |
排序方式: 共有4454条查询结果,搜索用时 31 毫秒
61.
Ivar Ugi Johannes Bauer Klemens Bley Alf Dengler Andreas Dietz Eric Fontain Bernhard Gruber Rainer Herges Michael Knauer Klaus Reitsam Natalie Stein 《Angewandte Chemie (International ed. in English)》1993,32(2):201-227
The topic of this article is the development and the present state of the art of computer chemistry, the computer-assisted solution of chemical problems. Initially the problems in computer chemistry were confined to structure elucidation on the basis of spectroscopic data, then programs for synthesis design based on libraries of reaction data for relatively narrow classes of target compounds were developed, and now computer programs for the solution of a great variety of chemical problems are available or are under development. Previously it was an achievement when any solution of a chemical problem could be generated by computer assistance. Today, the main task is the efficient, transparent, and non-arbitrary selection of meaningful results from the immense set of potential solutions—that also may contain innovative proposals. Chemistry has two aspects, constitutional chemistry and stereochemistry, which are interrelated, but still require different approaches. As a result, about twenty years ago, an algebraic model of the logical structure of chemistry was presented that consisted of two parts: the constitution-oriented algebra of be- and r-matrices, and the theory of the stereochemistry of the chemical identity group. New chemical definitions, concepts, and perspectives are characteristic of this logic-oriented model, as well as the direct mathematical representation of chemical processes. This model enables the implementation of formal reaction generators that can produce conceivable solutions to chemical problems—including unprecedented solutions—without detailed empirical chemical information. New formal selection procedures for computer-generated chemical information are also possible through the above model. It is expedient to combine these with interactive methods of selection. In this review, the Munich project is presented and discussed in detail. It encompasses the further development and implementation of the mathematical model of the logical structure of chemistry as well as the experimental verification of the computer-generated results. The article concludes with a review of new reactions, reagents, and reaction mechanisms that have been found with the PC-programs IGOR and RAIN. 相似文献
62.
Cyclisation of the title compounds leads to mixtures of the expected 4H-cyclopental[b]pyrrol-4-ones (1), the corresponding 6-ones (3) by a single rearrangement, and the cyclopenta[c]pyrrol-4-ones (4) by a double rearrangement, the proportions depending upon the substituents.The 1H NMR spectra of 2-methyl-4H-cyctopenta[b]thiophen-6-one (3f) shows 6J long range coupling, but this is absent in the corresponding pyrroles (3c,d). The 13C spectra of 1 and 3 cannot be interpreted on the basis of substituent chemical shifts in pyrroles and thiophens, and are clearly -CH = CH-X (X = NMe, NPh, S) bridged derivatives of cyclopent-2-enone. 相似文献
63.
Quintanar L Yoon J Aznar CP Palmer AE Andersson KK Britt RD Solomon EI 《Journal of the American Chemical Society》2005,127(40):13832-13845
64.
Heterogeneous fluorescence immunoassays have been automated using flow injection manifolds incorporating thiophilic gel solid phase reactors to separate antibody-bound and unbound analyte molecules. Antibody elution is achieved by changes in ionic strength, thus allowing the use of pH sensitive fluorescent labels. This facilitates the development of dual analyte systems, in which two competitive immunoassays with separate labels are monitored in parallel. Detection of the fluorophores by high speed synchronous fluorescence scanning while the flow is briefly stopped utilises either one synchronous interval which detects both fluorophores, or two separate scans at different wavelength intervals, one for each fluorophore. Simultaneous analyses of serum albumin and transferrin exemplify these novel approaches. Spectroscopic interferences are very small, analyte recoveries are close to 100%, with a relative standard deviation of 5-6% and a sampling rate of 20 h-1. 相似文献
65.
The technique of bead injection has been adapted for surface enhanced Raman scattering (SERS) to substantially improve precision, long term stability and sensitivity of SERS detection in analytical chemistry. For this purpose a fully automated flow system comprising a dedicated flow-cell has been developed and tested. With the developed flow-cell, which contains two inlet and two outlet channels, it is possible to retain, perfuse and discharge minute amounts of polymer beads while monitoring all steps by Raman spectroscopy. First, beads carrying cation exchanger moieties were retained in the flow-cell and subsequently perfused with a silver nitrate and a hydroxylamine solution using one inlet of the flow cell. By this sequence homogeneous SERS active silver layers were formed on the beads. The uniformity of the achieved silver layer was studied by secondary electron microscopy. For measurement, the analyte was then introduced from the second inlet channel such that the interaction between the activated SERS beads and analyte occurred in close proximity and within the focus of the laser excitation beam. Due to the complete computer control of all experimental steps, including bead entrapment, SERS layer generation, sample introduction and final bead removal, highly reproducible conditions for SERS were achieved. The method was developed using 9-aminoacridine as a test molecule. Quantitative studies were carried out for 9-aminoacridine and acridine showing linear calibrations from 1-100 nmol l(-1) and 50-1,000 nmol l(-1), respectively, using a sample volume of 200 microl each. Typical relative standard deviations were 4.7% for 9-aminoacrine and 5.8% for acridine. 相似文献
66.
Tapan K. Chattopadhyay Rex A Palmer Daruka Mahadevan 《Journal of chemical crystallography》1995,25(4):195-199
The crystal and molecular structure of pindolol, 1-(1H indol-4-yloxy)-3-[(1-methylethyl)amino]-2-propanol, has been determined by direct methods. Crystals are tetragonal,
,a=b=15.809(4),c=11.246(2) Å,Z=8,D
c=1.174 mg m–3. The finalR-factor for 2271 reflections withI>2(I) is 0.038. Refinement by full-matrix least-squares on F2 also enabled the absolute configuration of the structure to be established. The molecule is essentially planar, including much of the side-chain which is stabilized by the existence of two intramolecular H-bonds, between the ethyl oxygen and OH group, and between the OH and side-chain amide groups, respectively. The crystal structure is formed by three intermolecular hydrogen bonds including two side-chain-side-chain interactions, between ethyl oxygen to amide and OH to amide, and an interaction between the side-chain OH to indole NH. 相似文献
67.
Johannes Blümlein 《Zeitschrift fur Physik C Particles and Fields》1995,65(2):293-298
The QED radiative corrections are calculated in the leading log approximation up to $\mathcal{O}(\alpha ^2 )$ for different definitions of the kinematical variables using jet measurement, the ‘mixed’ variables, the double angle method, and a measurement based onθ e andy JB . Higher order contributions due to exponentiation of soft radiation are included. 相似文献
68.
69.
Cinabro D Henderson S Liu T Saulnier M Wilson R Yamamoto H Bergfeld T Eisenstein BI Gollin G Ong B Palmer M Selen M Thaler JJ Sadoff AJ Ammar R Ball S Baringer P Bean A Besson D Coppage D Copty N Davis R Hancock N Kelly M Kwak N Lam H Kubota Y Lattery M Nelson JK Patton S Perticone D Poling R Savinov V Schrenk S Wang R Alam MS Kim IJ Nemati B O'Neill JJ Severini H Sun CR Zoeller MM Crawford G Daubenmier CM Fulton R Fujino D Gan KK Honscheid K Kagan H Kass R Lee J Malchow R Morrow F Skovpen Y 《Physical review letters》1994,72(10):1406-1410
70.
Balest R Cho K Daoudi M Ford WT Johnson DR Lingel K Lohner M Rankin P Smith JG Alexander JP Bebek C Berkelman K Bloom K Browder TE Cassel DG Cho HA Coffman DM Drell PS Ehrlich R Gaiderev P Garcia-Sciveres M Geiser B Gittelman B Gray SW Hartill DL Heltsley BK Jones CD Jones SL Kandaswamy J Katayama N Kim PC Kreinick DL Ludwig GS Masui J Mevissen J Mistry NB Ng CR Nordberg E Patterson JR Peterson D Riley D Salman S Sapper M Würthwein F Avery P Freyberger A Rodriguez J Stephens R Yang S Yelton J 《Physical review letters》1994,72(15):2328-2331